program print_tc_energy BEGIN_DOC ! TODO : Put the documentation of the program here END_DOC implicit none read_wf = .True. touch read_wf my_grid_becke = .True. PROVIDE tc_grid1_a tc_grid1_r my_n_pt_r_grid = tc_grid1_r my_n_pt_a_grid = tc_grid1_a touch my_grid_becke my_n_pt_r_grid my_n_pt_a_grid call write_int(6, my_n_pt_r_grid, 'radial external grid over') call write_int(6, my_n_pt_a_grid, 'angular external grid over') if(tc_integ_type .eq. "numeric") then my_extra_grid_becke = .True. PROVIDE tc_grid2_a tc_grid2_r my_n_pt_r_extra_grid = tc_grid2_r my_n_pt_a_extra_grid = tc_grid2_a touch my_extra_grid_becke my_n_pt_r_extra_grid my_n_pt_a_extra_grid call write_int(6, my_n_pt_r_extra_grid, 'radial internal grid over') call write_int(6, my_n_pt_a_extra_grid, 'angular internal grid over') endif call main() end ! --- subroutine main() implicit none PROVIDE j2e_type PROVIDE j1e_type PROVIDE env_type print *, ' j2e_type = ', j2e_type print *, ' j1e_type = ', j1e_type print *, ' env_type = ', env_type call write_tc_energy() end